N-(3-methylbutyl)-1-(3-methylphenyl)-5-phenyl-1,2,4-triazole-3-carboxamide

Systemtic Name: N-(3-methylbutyl)-1-(3-methylphenyl)-5-phenyl-1,2,4-triazole-3-carboxamide Openeye Name: N-isopentyl-1-(m-tolyl)-5-phenyl-1,2,4-triazole-3-carboxamide CAS Name: N-(3-methylbutyl)-1-(3-methylphenyl)-5-phenyl-1,2,4-triazole-3-carboxamide IUPAC Name: N-(3-methylbutyl)-1-(3-methylphenyl)-5-phenyl-1,2,4-triazole-3-carboxamide Traditional Name: N-isoamyl-1-(m-tolyl)-5-phenyl-1,2,4-triazole-3-carboxamide Formula: C21H24N4O MolecularWeight: 348.44146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NC(=N2)C(=O)NCCC(C)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NC(=N2)C(=O)NCCC(C)C)C3=CC=CC=C3

InChI

InChI=1S/C21H24N4O/c1-15(2)12-13-22-21(26)19-23-20(17-9-5-4-6-10-17)25(24-19)18-11-7-8-16(3)14-18/h4-11,14-15H,12-13H2,1-3H3,(H,22,26)